1-[6-[4-[4-(phenylmethyl)phthalazin-1-yl]piperazin-1-yl]pyridin-3-yl]ethanone

Systemtic Name: 1-[6-[4-[4-(phenylmethyl)phthalazin-1-yl]piperazin-1-yl]pyridin-3-yl]ethanone Openeye Name: 1-[6-[4-(4-benzylphthalazin-1-yl)piperazin-1-yl]-3-pyridyl]ethanone CAS Name: 1-[6-[4-[4-(phenylmethyl)-1-phthalazinyl]-1-piperazinyl]-3-pyridinyl]ethanone IUPAC Name: 1-[6-[4-(4-benzylphthalazin-1-yl)piperazin-1-yl]pyridin-3-yl]ethanone Traditional Name: 1-[6-[4-(4-benzylphthalazin-1-yl)piperazino]-3-pyridyl]ethanone Formula: C26H25N5O MolecularWeight: 423.5096

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CN=C(C=C1)N2CCN(CC2)C3=NN=C(C4=CC=CC=C43)CC5=CC=CC=C5

Isomeric SMILES

CC(=O)C1=CN=C(C=C1)N2CCN(CC2)C3=NN=C(C4=CC=CC=C43)CC5=CC=CC=C5

InChI

InChI=1S/C26H25N5O/c1-19(32)21-11-12-25(27-18-21)30-13-15-31(16-14-30)26-23-10-6-5-9-22(23)24(28-29-26)17-20-7-3-2-4-8-20/h2-12,18H,13-17H2,1H3